Geometry & MOs

Info

ID:	359753
PubChem CID:	127299700
Reduced:	SN3O5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	393.241627
ΔH_f, kcal/mol:	-216.6
Dipole, Da:	5.19
IP(EA), eV:	-8.6(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2-oxo-N-[1-(1-phenylethyl)pyrrolidin-3-yl]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=CC1=O)NC(=O)C2CCCCC2C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations